BDBM683793 2-{[(2R,7aS)-2- fluoro- hexahydro-1H- pyrrolizin-7a- yl]methoxy}-4- [(1S,6R)-3,9- diazabicyclo[4.2. 1]nonan-3-yl]- 7-(8- ethylnaphthalen- 1-yl)-8- fluoroquinazoline::US20240217982, Example 11-8

SMILES CCc1cccc2cccc(-c3ccc4c(nc(OC[C@@]56CCCN5C[C@H](F)C6)nc4c3F)N3CC[C@H]4CC[C@@H](C3)N4)c12

InChI Key InChIKey=OZSCECWMBWPLQA-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 683793   

TargetGTPase KRas [G12D](Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM683793(US20240217982, Example 11-8 | 2-{[(2R,7aS)-2- fluo...)
Affinity DataIC50: 2.00E+3nMAssay Description:Recombinant GDP-loaded KRAS G12D (20 nM) was treated with compound at room temperature for 20 minutes in assay buffer (10 mM Hepes pH 7.4, 150 mM NaC...More data for this Ligand-Target Pair
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Date in BDB:
10/11/2024
Entry Details
US Patent